4-[[2-(cyclopropylcarbonylamino)-5-methyl-thiophen-3-yl]carbonylamino]benzoic acid

Systemtic Name: 4-[[2-(cyclopropylcarbonylamino)-5-methyl-thiophen-3-yl]carbonylamino]benzoic acid Openeye Name: 4-[[2-(cyclopropanecarbonylamino)-5-methyl-thiophene-3-carbonyl]amino]benzoic acid CAS Name: 4-[[[2-[[cyclopropyl(oxo)methyl]amino]-5-methyl-3-thiophenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[2-(cyclopropanecarbonylamino)-5-methylthiophene-3-carbonyl]amino]benzoic acid Traditional Name: 4-[[2-(cyclopropanecarbonylamino)-5-methyl-thiophene-3-carbonyl]amino]benzoic acid Formula: C17H16N2O4S MolecularWeight: 344.38494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2CC2)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2CC2)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H16N2O4S/c1-9-8-13(16(24-9)19-14(20)10-2-3-10)15(21)18-12-6-4-11(5-7-12)17(22)23/h4-8,10H,2-3H2,1H3,(H,18,21)(H,19,20)(H,22,23)